[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 4-phenoxybenzoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 4-phenoxybenzoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 4-phenoxybenzoate CAS Name: 4-phenoxybenzoic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 4-phenoxybenzoate Traditional Name: 4-phenoxybenzoic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C19H13BrO4S MolecularWeight: 417.27312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C19H13BrO4S/c20-18-11-10-17(25-18)16(21)12-23-19(22)13-6-8-15(9-7-13)24-14-4-2-1-3-5-14/h1-11H,12H2